private void setValue(ModelCompound compound, string parameterName, double value) { var parameter = compound.Parameter(parameterName); parameter.Value = value; _batchLogger.AddParameterValueToDebug(parameter); }
private void setPka(ModelCompound compound, PkaType pkaType, int i) { var type = EnumHelper.ParseValue <CompoundType>(pkaType.Type); setValue(compound, CoreConstants.Parameter.ParameterCompoundType(i), (int)type); setValue(compound, CoreConstants.Parameter.ParameterPKa(i), pkaType.Value); }
private void setValue(ModelCompound compound, string alternativeName, string parameterName, double value) { var alternative = compound.ParameterAlternativeGroup(alternativeName).DefaultAlternative; var parameter = alternative.Parameter(parameterName); parameter.Value = value; _batchLogger.AddParameterValueToDebug(parameter); }
public ObservedDataToCompoundMappingPresenter(IObservedDataToCompoundMappingView view, ICompoundFactory compoundFactory) : base(view) { _compoundFactory = compoundFactory; _undefinedCompound = _compoundFactory.Create().WithName(PKSimConstants.UI.Undefined); _allAvailableCompounds = new List <PKSim.Core.Model.Compound> { _undefinedCompound }; view.CancelVisible = false; }
protected override Task Context() { sut = new ProcessMappingMapper(); _compound = new Compound { Name = "COMP", }; _enzymaticProcess = new EnzymaticProcess().WithName("MetaProcess"); _enzymaticProcessSelection = new EnzymaticProcessSelection { CompoundName = _compound.Name, MetaboliteName = "META", MoleculeName = "CYP", ProcessName = _enzymaticProcess.Name }; _specificBindingProcess = new SpecificBindingPartialProcess().WithName("BindingProcess"); _specificBindingPartialProcessSelection = new ProcessSelection { CompoundName = _compound.Name, MoleculeName = "BINDER", ProcessName = _specificBindingProcess.Name }; _transportSystemicProcess = new SystemicProcess { Name = "SystemicTransport", SystemicProcessType = SystemicProcessTypes.GFR }; _transportSystemicProcessSelection = new SystemicProcessSelection { CompoundName = _compound.Name, ProcessName = _transportSystemicProcess.Name, ProcessType = _transportSystemicProcess.SystemicProcessType }; _interactionProcess = new InductionProcess().WithName("InteractionProcess"); _interactionSelection = new InteractionSelection { CompoundName = _compound.Name, ProcessName = _interactionProcess.Name, MoleculeName = "INHIBITOR" }; _compound.AddProcess(_enzymaticProcess); _compound.AddProcess(_transportSystemicProcess); _compound.AddProcess(_interactionProcess); _compound.AddProcess(_specificBindingProcess); return(_completed); }
public ParameterAlternative CreateCompoundAlternative(Compound compound, string group, string alternativeName, double value, string parameterName, bool setDefault = true) { var alternativeGroup = compound.ParameterAlternativeGroup(group); var alternative = _parameterAlternativeFactory.CreateAlternativeFor(alternativeGroup).WithName(alternativeName); AddCommand(_compoundAlternativeTask.AddParameterGroupAlternativeTo(alternativeGroup, alternative)); AddCommand(_compoundAlternativeTask.SetAlternativeParameterValue(alternative.Parameter(parameterName), value)); if (setDefault) { AddCommand(_compoundAlternativeTask.SetDefaultAlternativeFor(alternativeGroup, alternative)); } return(alternative); }
public static Simulation CreateSimulationWith(ISimulationSubject simulationSubject, Compound compound, Protocol protocol, string modelName, Formulation formulation = null) { var simulation = createModelLessSimulationWith(simulationSubject, compound, protocol, modelName, formulation); AddModelToSimulation(simulation); return(simulation); }
public static Simulation CreateModelLessSimulationWith(ISimulationSubject simulationSubject, Compound compound, Protocol protocol, ModelProperties modelProperties, bool allowAging = false, Formulation formulation = null) { return(CreateModelLessSimulationWith(simulationSubject, new[] { compound }, new[] { protocol }, modelProperties, allowAging, formulation)); }
public static Simulation CreateModelLessSimulationWith(ISimulationSubject simulationSubject, Compound compound, Protocol protocol, bool allowAging = false, Formulation formulation = null) { return(CreateModelLessSimulationWith(simulationSubject, compound, protocol, CreateDefaultModelPropertiesFor(simulationSubject), allowAging, formulation)); }
public static Simulation CreateSimulationWith(ISimulationSubject simulationSubject, Compound compound, Protocol protocol, Formulation formulation, bool allowAging = false) { var simulation = CreateModelLessSimulationWith(simulationSubject, compound, protocol, allowAging, formulation); AddModelToSimulation(simulation); return(simulation); }
private static Simulation createModelLessSimulationWith(ISimulationSubject simulationSubject, Compound compound, Protocol protocol, string modelName, Formulation formulation = null) { return(CreateModelLessSimulationWith(simulationSubject, compound, protocol, CreateModelPropertiesFor(simulationSubject, modelName), false, formulation)); }
public ParameterAlternative CreateLipophilicityAlternative(Compound compound, string alternativeName, double value, bool setDefault = true) { return(CreateCompoundAlternative(compound, CoreConstants.Groups.COMPOUND_LIPOPHILICITY, alternativeName, value, CoreConstants.Parameter.LIPOPHILICITY, setDefault)); }
public PartialProcessDTO MapFrom(PKSim.Core.Model.PartialProcess partialProcess, PKSim.Core.Model.Compound compound) { return(new PartialProcessDTO(partialProcess) { MoleculeName = partialProcess.MoleculeName, DataSource = partialProcess.DataSource, Compound = compound, Species = partialProcess.Species }); }
protected override Task Context() { _classificationMapper = A.Fake <ClassificationMapper>(); _snapshotMapper = A.Fake <ISnapshotMapper>(); _executionContext = A.Fake <IExecutionContext>(); _lazyLoadTask = A.Fake <ILazyLoadTask>(); _simulationMapper = A.Fake <SimulationMapper>(); _simulationComparisonMapper = A.Fake <SimulationComparisonMapper>(); _parameterIdentificationMapper = A.Fake <ParameterIdentificationMapper>(); _classificationSnapshotTask = A.Fake <IClassificationSnapshotTask>(); _qualificationPlanMapper = A.Fake <QualificationPlanMapper>(); _creationMetaDataFactory = A.Fake <ICreationMetaDataFactory>(); _logger = A.Fake <ILogger>(); sut = new ProjectMapper( _simulationMapper, _simulationComparisonMapper, _parameterIdentificationMapper, _qualificationPlanMapper, _executionContext, _classificationSnapshotTask, _lazyLoadTask, _creationMetaDataFactory, _logger); A.CallTo(() => _executionContext.Resolve <ISnapshotMapper>()).Returns(_snapshotMapper); _individual = new Individual().WithName("IND"); _compound = new Compound().WithName("COMP"); _event = new PKSimEvent().WithName("EVENT"); _formulation = new Formulation().WithName("FORM"); _protocol = new SimpleProtocol().WithName("PROTO"); _population = new RandomPopulation().WithName("POP"); _observedData = new DataRepository().WithName("OD"); _parameterIdentification = new OSPSuite.Core.Domain.ParameterIdentifications.ParameterIdentification().WithName("PI").WithId("PI_ID"); _classifiableObservedData = new ClassifiableObservedData { Subject = _observedData }; _classification = new Classification { ClassificationType = ClassificationType.ObservedData }.WithName("OD Classification"); _simulationComparison = new IndividualSimulationComparison().WithName("COMP").WithId("SimComp"); _simulation = new IndividualSimulation().WithName("IND_SIM").WithId("IndSim"); _qualificationPlan = new QualificationPlan().WithName("QP").WithId("QP_ID"); _project = new PKSimProject(); _project.AddBuildingBlock(_individual); _project.AddBuildingBlock(_compound); _project.AddBuildingBlock(_event); _project.AddBuildingBlock(_formulation); _project.AddBuildingBlock(_protocol); _project.AddBuildingBlock(_population); _project.AddObservedData(_observedData); _project.AddBuildingBlock(_simulation); _project.AddClassifiable(_classifiableObservedData); _project.AddClassification(_classification); _project.AddSimulationComparison(_simulationComparison); _project.AddParameterIdentification(_parameterIdentification); _project.AddQualificationPlan(_qualificationPlan); _compoundSnapshot = new Snapshots.Compound(); _individualSnapshot = new Snapshots.Individual(); _eventSnapshot = new Event(); _formulationSnapshot = new Snapshots.Formulation(); _protocolSnapshot = new Snapshots.Protocol(); _populationSnapshot = new Snapshots.Population(); _observedDataSnapshot = new Snapshots.DataRepository(); _parameterIdentificationSnapshot = new ParameterIdentification(); _observedDataClassificationSnapshot = new Snapshots.Classification(); _simulationComparisonSnapshot = new SimulationComparison(); _simulationClassificationSnapshot = new Snapshots.Classification(); _comparisonClassificationSnapshot = new Snapshots.Classification(); _parameterIdentificationClassificationSnapshot = new Snapshots.Classification(); _qualificationPlanClassificationSnapshot = new Snapshots.Classification(); _qualificationPlanSnapshot = new Snapshots.QualificationPlan(); _simulationSnapshot = new Simulation(); A.CallTo(() => _snapshotMapper.MapToSnapshot(_compound)).Returns(_compoundSnapshot); A.CallTo(() => _snapshotMapper.MapToSnapshot(_individual)).Returns(_individualSnapshot); A.CallTo(() => _snapshotMapper.MapToSnapshot(_event)).Returns(_eventSnapshot); A.CallTo(() => _snapshotMapper.MapToSnapshot(_formulation)).Returns(_formulationSnapshot); A.CallTo(() => _snapshotMapper.MapToSnapshot(_protocol)).Returns(_protocolSnapshot); A.CallTo(() => _snapshotMapper.MapToSnapshot(_population)).Returns(_populationSnapshot); A.CallTo(() => _snapshotMapper.MapToSnapshot(_observedData)).Returns(_observedDataSnapshot); A.CallTo(() => _simulationMapper.MapToSnapshot(_simulation, _project)).Returns(_simulationSnapshot); A.CallTo(() => _simulationComparisonMapper.MapToSnapshot(_simulationComparison)).Returns(_simulationComparisonSnapshot); A.CallTo(() => _parameterIdentificationMapper.MapToSnapshot(_parameterIdentification, _project)).Returns(_parameterIdentificationSnapshot); A.CallTo(() => _qualificationPlanMapper.MapToSnapshot(_qualificationPlan)).Returns(_qualificationPlanSnapshot); A.CallTo(() => _classificationSnapshotTask.MapClassificationsToSnapshots <ClassifiableObservedData>(_project)).Returns(new[] { _observedDataClassificationSnapshot }); A.CallTo(() => _classificationSnapshotTask.MapClassificationsToSnapshots <ClassifiableSimulation>(_project)).Returns(new[] { _simulationClassificationSnapshot }); A.CallTo(() => _classificationSnapshotTask.MapClassificationsToSnapshots <ClassifiableComparison>(_project)).Returns(new[] { _comparisonClassificationSnapshot }); A.CallTo(() => _classificationSnapshotTask.MapClassificationsToSnapshots <ClassifiableParameterIdentification>(_project)).Returns(new[] { _parameterIdentificationClassificationSnapshot }); A.CallTo(() => _classificationSnapshotTask.MapClassificationsToSnapshots <ClassifiableQualificationPlan>(_project)).Returns(new[] { _qualificationPlanClassificationSnapshot }); return(_completed); }
protected abstract void EditProcess(TProcess process, PKSim.Core.Model.Compound compound);
protected override Task Context() { _calculationMethodCacheMapper = A.Fake <CalculationMethodCacheMapper>(); _processMappingMapper = A.Fake <ProcessMappingMapper>(); _logger = A.Fake <ILogger>(); _project = new PKSimProject(); _calculationMethodSnapshot = new CalculationMethodCache(); sut = new CompoundPropertiesMapper(_calculationMethodCacheMapper, _processMappingMapper, _logger); _compoundGroupSelectionOneAlternative = new CompoundGroupSelection { AlternativeName = "ALT1", GroupName = "ALTERNATIVE_GROUP_1" }; _compoundGroupSelectionTwoAlternatives = new CompoundGroupSelection { AlternativeName = "ALT2", GroupName = "ALTERNATIVE_GROUP_2" }; _compound = new Compound { Name = "COMP", }; _protocol = new SimpleProtocol { Name = "PROTOCOL" }; _parameterAlternativeGroupWithOneAlternative = new ParameterAlternativeGroup { Name = _compoundGroupSelectionOneAlternative.GroupName }; _parameterAlternativeGroupWithTwoAlternatives = new ParameterAlternativeGroup { Name = _compoundGroupSelectionTwoAlternatives.GroupName }; _parameterAlternativeGroupWithTwoAlternatives.AddAlternative(new ParameterAlternative { Name = "ALT1" }); _parameterAlternativeGroupWithTwoAlternatives.AddAlternative(new ParameterAlternative { Name = "ALT2" }); _compound.AddParameterAlternativeGroup(_parameterAlternativeGroupWithOneAlternative); _compound.AddParameterAlternativeGroup(_parameterAlternativeGroupWithTwoAlternatives); _compoundProperties = new Model.CompoundProperties(); _compoundProperties.AddCompoundGroupSelection(_compoundGroupSelectionOneAlternative); _compoundProperties.AddCompoundGroupSelection(_compoundGroupSelectionTwoAlternatives); _compoundProperties.Compound = _compound; _enzymaticProcess = new EnzymaticProcess { Name = "EnzymaticProcess" }; _anotherEnzymaticProcess = new EnzymaticProcess { Name = "AnotherEnzymaticProcess", MoleculeName = "CYP3A4" }; _specificBindingProcess = new SpecificBindingPartialProcess { Name = "SpecificBinding" }; _gfrTransportProcess = new SystemicProcess { Name = "Transport", SystemicProcessType = SystemicProcessTypes.GFR }; _hepaticEnzymaticProcess = new SystemicProcess { Name = "Plasma Clearance", SystemicProcessType = SystemicProcessTypes.Hepatic }; _compound.AddProcess(_enzymaticProcess); _compound.AddProcess(_specificBindingProcess); _compound.AddProcess(_gfrTransportProcess); _compound.AddProcess(_hepaticEnzymaticProcess); _enzymaticPartialProcessSelection = new EnzymaticProcessSelection { ProcessName = _enzymaticProcess.Name }; _noEnzymaticSystemicProcessSelection = new SystemicProcessSelection { ProcessType = SystemicProcessTypes.Hepatic }; _specificBindingPartialProcessSelection = new ProcessSelection { ProcessName = _specificBindingProcess.Name }; _transportSystemicProcessSelection = new SystemicProcessSelection { ProcessName = _gfrTransportProcess.Name, ProcessType = _gfrTransportProcess.SystemicProcessType, }; _noEnzymaticPartialProcessSelection = new EnzymaticProcessSelection { MoleculeName = _anotherEnzymaticProcess.MoleculeName }; _compoundProperties.Processes.MetabolizationSelection.AddPartialProcessSelection(_enzymaticPartialProcessSelection); _compoundProperties.Processes.MetabolizationSelection.AddPartialProcessSelection(_noEnzymaticPartialProcessSelection); _compoundProperties.Processes.MetabolizationSelection.AddSystemicProcessSelection(_noEnzymaticSystemicProcessSelection); _compoundProperties.Processes.SpecificBindingSelection.AddPartialProcessSelection(_specificBindingPartialProcessSelection); _compoundProperties.Processes.TransportAndExcretionSelection.AddSystemicProcessSelection(_transportSystemicProcessSelection); _snapshotProcess1 = new CompoundProcessSelection { Name = _enzymaticPartialProcessSelection.ProcessName }; _snapshotProcess2 = new CompoundProcessSelection { Name = _specificBindingPartialProcessSelection.ProcessName }; _snapshotProcess3 = new CompoundProcessSelection { Name = _transportSystemicProcessSelection.ProcessName }; _snapshotProcess4 = new CompoundProcessSelection { SystemicProcessType = _noEnzymaticSystemicProcessSelection.ProcessType.SystemicProcessTypeId.ToString() }; _snapshotProcess5 = new CompoundProcessSelection { MoleculeName = _noEnzymaticPartialProcessSelection.MoleculeName }; _formulation = new Formulation { Id = "123456" }; _compoundProperties.ProtocolProperties.Protocol = _protocol; _compoundProperties.ProtocolProperties.AddFormulationMapping(new FormulationMapping { FormulationKey = "F1", TemplateFormulationId = _formulation.Id }); _project.AddBuildingBlock(_formulation); A.CallTo(() => _calculationMethodCacheMapper.MapToSnapshot(_compoundProperties.CalculationMethodCache)).Returns(_calculationMethodSnapshot); A.CallTo(() => _processMappingMapper.MapToSnapshot(_enzymaticPartialProcessSelection)).Returns(_snapshotProcess1); A.CallTo(() => _processMappingMapper.MapToSnapshot(_specificBindingPartialProcessSelection)).Returns(_snapshotProcess2); A.CallTo(() => _processMappingMapper.MapToSnapshot(_transportSystemicProcessSelection)).Returns(_snapshotProcess3); A.CallTo(() => _processMappingMapper.MapToSnapshot(_noEnzymaticSystemicProcessSelection)).Returns(_snapshotProcess4); A.CallTo(() => _processMappingMapper.MapToSnapshot(_noEnzymaticPartialProcessSelection)).Returns(_snapshotProcess5); A.CallTo(() => _processMappingMapper.MapToModel(_snapshotProcess1, _enzymaticProcess)).Returns(_enzymaticPartialProcessSelection); A.CallTo(() => _processMappingMapper.MapToModel(_snapshotProcess2, _specificBindingProcess)).Returns(_specificBindingPartialProcessSelection); A.CallTo(() => _processMappingMapper.MapToModel(_snapshotProcess3, _gfrTransportProcess)).Returns(_transportSystemicProcessSelection); A.CallTo(() => _processMappingMapper.MapToModel(_snapshotProcess4, A <NotSelectedSystemicProcess> ._)).Returns(_noEnzymaticSystemicProcessSelection); A.CallTo(() => _processMappingMapper.MapToModel(_snapshotProcess5, A <EnzymaticProcess> ._)).Returns(_noEnzymaticPartialProcessSelection); return(_completed); }
protected abstract void Rebind(TProcess process, PKSim.Core.Model.Compound compound);
protected override Task Context() { _solverSettingsMapper = A.Fake <SolverSettingsMapper>(); _outputSchemaMapper = A.Fake <OutputSchemaMapper>(); _outputSelectionMapper = A.Fake <OutputSelectionsMapper>(); _parameterMapper = A.Fake <ParameterMapper>(); _compoundPropertiesMapper = A.Fake <CompoundPropertiesMapper>(); _advancedParameterMapper = A.Fake <AdvancedParameterMapper>(); _eventMappingMapper = A.Fake <EventMappingMapper>(); _observerSetMappingMapper = A.Fake <ObserverSetMappingMapper>(); _curveChartMapper = A.Fake <SimulationTimeProfileChartMapper>(); _processMappingMapper = A.Fake <ProcessMappingMapper>(); _simulationFactory = A.Fake <ISimulationFactory>(); _executionContext = A.Fake <IExecutionContext>(); _simulationModelCreator = A.Fake <ISimulationModelCreator>(); _simulationBuildingBlockUpdater = A.Fake <ISimulationBuildingBlockUpdater>(); _modelPropertiesTask = A.Fake <IModelPropertiesTask>(); _simulationRunner = A.Fake <ISimulationRunner>(); _populationAnalysisChartMapper = A.Fake <PopulationAnalysisChartMapper>(); _simulationParameterOriginIdUpdater = A.Fake <ISimulationParameterOriginIdUpdater>(); _logger = A.Fake <ILogger>(); _containerTask = A.Fake <IContainerTask>(); _entityPathResolver = A.Fake <IEntityPathResolver>(); sut = new SimulationMapper(_solverSettingsMapper, _outputSchemaMapper, _outputSelectionMapper, _compoundPropertiesMapper, _parameterMapper, _advancedParameterMapper, _eventMappingMapper, _observerSetMappingMapper, _curveChartMapper, _populationAnalysisChartMapper, _processMappingMapper, _simulationFactory, _executionContext, _simulationModelCreator, _simulationBuildingBlockUpdater, _modelPropertiesTask, _simulationRunner, _simulationParameterOriginIdUpdater, _logger, _containerTask, _entityPathResolver ); _project = new PKSimProject(); _individual = new Individual { Name = "IND", Id = "IND" }; _compound = new Compound { Name = "COMP", Id = "COMP" }; _observerSet = new ObserverSet { Name = "OBS_SET", Id = "OBS_SET" }; _protocol = new SimpleProtocol { Name = "PROT", Id = "PROT" }; _inductionProcess = new InductionProcess().WithName("Interaction process"); _compound.AddProcess(_inductionProcess); _event = new PKSimEvent { Name = "Event" }; _population = new RandomPopulation() { Name = "POP" }; _observedData = new DataRepository("OBS_ID").WithName("OBS"); _project.AddBuildingBlock(_individual); _project.AddBuildingBlock(_compound); _project.AddBuildingBlock(_event); _project.AddBuildingBlock(_population); _project.AddBuildingBlock(_observerSet); _project.AddObservedData(_observedData); _simulationProperties = new SimulationProperties { ModelProperties = new ModelProperties { ModelConfiguration = new ModelConfiguration { ModelName = "4Comp" } } }; _interactionSelection = new InteractionSelection { ProcessName = _inductionProcess.Name }; _noInteractionSelection = new InteractionSelection { MoleculeName = "CYP2D6" }; _simulationProperties.InteractionProperties.AddInteraction(_interactionSelection); _simulationProperties.InteractionProperties.AddInteraction(_noInteractionSelection); _settings = new SimulationSettings(); _rootContainer = new Container().WithName("Sim"); _model = new OSPSuite.Core.Domain.Model { Root = _rootContainer }; _individualSimulation = new IndividualSimulation { Name = "S1", Properties = _simulationProperties, SimulationSettings = _settings, Description = "Simulation Description", Model = _model }; _simulationTimeProfile = new SimulationTimeProfileChart(); _snapshotSimulationTimeProfile = new CurveChart(); _individualSimulation.AddAnalysis(_simulationTimeProfile); A.CallTo(() => _curveChartMapper.MapToSnapshot(_simulationTimeProfile)).Returns(_snapshotSimulationTimeProfile); _populationSimulation = new PopulationSimulation { Properties = _simulationProperties, SimulationSettings = _settings, Model = _model }; _advancedParameterCollection = new AdvancedParameterCollection(); _populationSimulationAnalysisChart = new BoxWhiskerAnalysisChart(); _populationSimulation.SetAdvancedParameters(_advancedParameterCollection); _populationSimulation.AddAnalysis(_populationSimulationAnalysisChart); _populationSimulation.AddUsedBuildingBlock(new UsedBuildingBlock("IndTemplateId", PKSimBuildingBlockType.Individual) { BuildingBlock = _individual }); _snapshotPopulationAnalysisChart = new Snapshots.PopulationAnalysisChart(); A.CallTo(() => _populationAnalysisChartMapper.MapToSnapshot(_populationSimulationAnalysisChart)).Returns(_snapshotPopulationAnalysisChart); _snapshotInteraction = new CompoundProcessSelection(); A.CallTo(() => _processMappingMapper.MapToSnapshot(_interactionSelection)).Returns(_snapshotInteraction); _snapshotInteraction.CompoundName = _compound.Name; _snapshotInteraction.Name = _inductionProcess.Name; _noSelectionSnapshotInteraction = new CompoundProcessSelection(); A.CallTo(() => _processMappingMapper.MapToSnapshot(_noInteractionSelection)).Returns(_noSelectionSnapshotInteraction); _noSelectionSnapshotInteraction.MoleculeName = _noInteractionSelection.MoleculeName; _compoundProperties = new CompoundProperties(); _snapshotCompoundProperties = new Snapshots.CompoundProperties { Name = _compound.Name }; _individualSimulation.Properties.AddCompoundProperties(_compoundProperties); _eventMapping = new EventMapping(); _individualSimulation.EventProperties.AddEventMapping(_eventMapping); _observerSetMapping = new ObserverSetMapping(); _individualSimulation.ObserverSetProperties.AddObserverSetMapping(_observerSetMapping); A.CallTo(() => _compoundPropertiesMapper.MapToSnapshot(_compoundProperties, _project)).Returns(_snapshotCompoundProperties); _eventSelection = new EventSelection { Name = _event.Name, }; _observerSetSelection = new ObserverSetSelection { Name = _observerSet.Name, }; _individualSimulation.AddUsedBuildingBlock(new UsedBuildingBlock("IndTemplateId", PKSimBuildingBlockType.Individual) { BuildingBlock = _individual, Altered = true }); _individualSimulation.AddUsedBuildingBlock(new UsedBuildingBlock("CompTemplateId", PKSimBuildingBlockType.Compound) { BuildingBlock = _compound }); _individualSimulation.AddUsedBuildingBlock(new UsedBuildingBlock("ProtTemplateId", PKSimBuildingBlockType.Protocol) { BuildingBlock = _protocol }); _individualSimulation.AddUsedBuildingBlock(new UsedBuildingBlock("ObserveSetTemplateId", PKSimBuildingBlockType.ObserverSet) { BuildingBlock = _observerSet }); _populationSimulation.AddUsedBuildingBlock(new UsedBuildingBlock("PopTemplateId", PKSimBuildingBlockType.Population) { BuildingBlock = _population }); _individualSimulation.AddUsedObservedData(_observedData); A.CallTo(() => _eventMappingMapper.MapToSnapshot(_eventMapping, _project)).Returns(_eventSelection); A.CallTo(() => _observerSetMappingMapper.MapToSnapshot(_observerSetMapping, _project)).Returns(_observerSetSelection); _outputSelectionSnapshot = new OutputSelections(); A.CallTo(() => _outputSelectionMapper.MapToSnapshot(_individualSimulation.OutputSelections)).Returns(_outputSelectionSnapshot); A.CallTo(() => _processMappingMapper.MapToModel(_snapshotInteraction, _inductionProcess)).Returns(_interactionSelection); return(_completed); }
private IndividualSimulation createForPKCalculation(IndividualSimulation originalSimulation, Compound compound, Action <Simulation, Compound, List <Protocol> > updateUsedProtocolsForSimulation) { var pkSimulation = createModelLessSimulationBasedOn(originalSimulation); //a new template was created. We need to retrieve by name var pkCompound = pkSimulation.Compounds.FindByName(compound.Name); //cache all protocols currently used by simulation var allProtocols = pkSimulation.AllBuildingBlocks <Protocol>().ToList(); //Remove them from the simulations pkSimulation.RemoveAllBuildingBlockOfType(PKSimBuildingBlockType.Protocol); //updates the list according to the action given updateUsedProtocolsForSimulation(pkSimulation, pkCompound, allProtocols); _simulationBuildingBlockUpdater.UpdateMultipleUsedBuildingBlockInSimulationFromTemplate(pkSimulation, allProtocols, PKSimBuildingBlockType.Protocol); updateCompoundProperties(pkSimulation); _simulationModelCreator.CreateModelFor(pkSimulation); //now update all parameters from the orginal simulation _simulationParametersUpdater.ReconciliateSimulationParametersBetween(originalSimulation, pkSimulation); return(pkSimulation); }